3-[1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanylpropanoic acid

Systemtic Name: 3-[1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanylpropanoic acid Openeye Name: 3-[2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]thio]propanoic acid IUPAC Name: 3-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]sulfanylpropanoic acid Traditional Name: 3-[[2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl]thio]propionic acid Formula: C9H16N2O4S MolecularWeight: 248.29934

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SCCC(=O)O

Isomeric SMILES

CCNC(=O)NC(=O)C(C)SCCC(=O)O

InChI

InChI=1S/C9H16N2O4S/c1-3-10-9(15)11-8(14)6(2)16-5-4-7(12)13/h6H,3-5H2,1-2H3,(H,12,13)(H2,10,11,14,15)